SCHEMBL3342354

SCHEMBL3342354

Cc1ccccc1C(=O)N1CCC[C@H](C(=O)O)[C@@H]1c1ccc(NC2CCCC2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.44
TP53 P04637 1/20 0.44
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
ITGB3 P05106 1/20 0.42
ITGB1 P05556 1/20 0.42
ITGAV P06756 1/20 0.42
ITGA5 P08648 1/20 0.42
ITGA4 P13612 1/20 0.42
HTT P42858 1/20 0.41
MAPT P10636 2/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
POLB P06746 1/20 0.40
CCR5 P51681 2/20 0.39
AVPR2 P30518 5/20 0.39
AVPR1A P37288 5/20 0.39
RECQL P46063 1/20 0.39
PAK1 Q13153 1/20 0.39
HRH3 Q9Y5N1 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3622996 0.89 HSD11B1 (0.45) KMT2ATP53RAB9AALDH1A1PAK1
SCHEMBL3347661 0.89 HSD11B1 (0.45) KMT2ATP53RAB9AALDH1A1PAK1
SCHEMBL2586547 0.87 CNR2 (0.43) KMT2ATP53NPC1RAB9AHTT
SCHEMBL9998804 0.87 CNR2 (0.43) KMT2ATP53NPC1RAB9AHTT
SCHEMBL16727612 0.87 CNR2 (0.43) KMT2ATP53NPC1RAB9AHTT
SCHEMBL18609854 0.87 CNR2 (0.43) KMT2ATP53NPC1RAB9AHTT
SCHEMBL18790097 0.85 CCR5 (0.40) KMT2AMAPTALDH1A1LMNACCR5
SCHEMBL18532541 0.85 CCR5 (0.40) KMT2AMAPTALDH1A1LMNACCR5
SCHEMBL2586526 0.85 CCR5 (0.40) KMT2AMAPTALDH1A1LMNACCR5
SCHEMBL2579732 0.84 CCR5 (0.39) KMT2AMAPTALDH1A1LMNACCR5

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230102258-A1 C5AR ANTAGONISTS CHEMOCENTRYX, INC. 2023-03-30 US disclosed
EP-4015504-A1 C5AR ANTAGONISTS ChemoCentryx, Inc. (US) 2022-06-22 EP disclosed
EP-3508477-B1 C5AR ANTAGONISTS CHEMOCENTRYX INC (US) 2021-11-10 EP disclosed
US-10660897-B2 C5aR antagonists CHEMOCENTRYX, INC. (US) 2020-05-26 US disclosed
EP-3078658-B1 C5AR ANTAGONISTS CHEMOCENTRYX INC (US) 2019-04-10 EP disclosed
US-10035768-B2 C5aR antagonists CHEMOCENTRYX, INC. (US) 2018-07-31 US disclosed
US-20180179160-A1 C5AR ANTAGONISTS CHEMOCENTRYX, INC. 2018-06-28 US disclosed
EP-2585064-B1 C5AR ANTAGONISTS CHEMOCENTRYX INC (US) 2017-05-03 EP disclosed
US-20170065604-A1 C5aR ANTAGONISTS CHEMOCENTRYX, INC. 2017-03-09 US disclosed
US-9573897-B2 C5AR antagonists CHEMOCENTRYX, INC. (US) 2017-02-21 US disclosed
US-20160229802-A1 C5AR ANTAGONISTS CHEMOCENTRYX, INC. 2016-08-11 US disclosed
EP-2381778-B1 C5AR ANTAGONISTS CHEMOCENTRYX INC (US) 2016-06-08 EP disclosed
US-9126939-B2 C5AR antagonists CHEMOCENTRYX, INC. 2015-09-08 US disclosed
US-20150141425-A1 C5aR ANTAGONISTS CHEMOCENTRYX, INC. 2015-05-21 US disclosed
US-8906938-B2 C5aR antagonists CHEMOCENTRYX, INC. (US) 2014-12-09 US disclosed
US-20130317028-A1 C5aR ANTAGONISTS CHEMOCENTRYX, INC. (US) 2013-11-28 US disclosed
US-20130172347-A1 C5AR ANTAGONISTS CHEMOCENTRYX, INC. 2013-07-04 US disclosed
US-8445515-B2 C5aR antagonists CHEMOCENTRYX, INC. (US) 2013-05-21 US disclosed
US-20100311753-A1 C5aR ANTAGONISTS CHEMOCENTRYX, INC. (US) 2010-12-09 US disclosed
US-20100160320-A1 C5aR ANTAGONISTS CHEMOCENTRYX, INC. (US) 2010-06-24 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (11 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100160320-A1 C5aR ANTAGONISTS C5AR1, C5AR2, C3AR1 KMT2A 4442/4885TP53 3390/4885NPC1 2134/4885
US-20150141425-A1 C5aR ANTAGONISTS C5AR1, C5AR2, C3AR1 KMT2A 4442/4885TP53 3390/4885NPC1 2134/4885
US-10660897-B2 C5aR antagonists C5AR1, C5AR2, C3AR1 KMT2A 4442/4885TP53 3390/4885NPC1 2134/4885
US-20160229802-A1 C5AR ANTAGONISTS C5AR1, C5AR2, C3AR1 KMT2A 4442/4885TP53 3390/4885NPC1 2134/4885
US-20180179160-A1 C5AR ANTAGONISTS C5AR1, C5AR2, C3AR1 KMT2A 4442/4885TP53 3390/4885NPC1 2134/4885
US-10035768-B2 C5aR antagonists C5AR1, C5AR2, C3AR1 KMT2A 4442/4885TP53 3390/4885NPC1 2134/4885
US-20130317028-A1 C5aR ANTAGONISTS C5AR1, C5AR2, C3AR1 KMT2A 4442/4885TP53 3390/4885NPC1 2134/4885
US-20230102258-A1 C5AR ANTAGONISTS C5AR1, C5AR2, C3AR1 KMT2A 4442/4885TP53 3390/4885NPC1 2134/4885
US-20100311753-A1 C5aR ANTAGONISTS C5AR1, C5AR2, C3AR1 KMT2A 4442/4885TP53 3390/4885NPC1 2134/4885
US-20130172347-A1 C5AR ANTAGONISTS C5AR1, C5AR2, C3AR1 KMT2A 4442/4885TP53 3390/4885NPC1 2134/4885
US-20170065604-A1 C5aR ANTAGONISTS C5AR1, C5AR2, C3AR1 KMT2A 4510/4885TP53 3892/4885NPC1 2536/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.